# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FR5' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C 2.59100 -3.32800 0.42300 1.000 N1 N 2.71500 -2.44900 -0.59900 1.000 C2 C 1.48000 -1.95300 -0.87100 1.000 N3 N 0.61900 -2.48900 -0.05500 1.000 C4 C 1.27100 -3.34800 0.77000 1.000 C5 C 0.66400 -4.15900 1.83900 1.000 O6 O 1.36000 -4.89500 2.51400 1.000 N7 N -0.66100 -4.08500 2.07100 1.000 C8 C 3.95700 -2.10000 -1.29300 1.000 C9 C 3.83100 -2.45500 -2.77600 1.000 O10 O 5.07600 -2.21100 -3.43200 1.000 C11 C 4.21900 -0.60000 -1.14800 1.000 C12 C 4.48000 -0.26800 0.32200 1.000 N13 N 4.64300 1.18000 0.47400 1.000 C14 C 5.84200 1.84100 0.48100 1.000 C15 C 5.63800 3.15800 0.63900 1.000 C16 C 4.19000 3.35800 0.74200 1.000 C17 C 3.61200 2.08000 0.63200 1.000 C18 C 3.37700 4.48100 0.91100 1.000 C19 C 2.02100 4.33600 0.97100 1.000 C20 C 1.44000 3.07300 0.86200 1.000 C21 C 2.23000 1.94800 0.69900 1.000 N22 N 0.04800 2.94100 0.92400 1.000 C23 C -0.57100 1.98400 0.20500 1.000 O24 O 0.06500 1.30100 -0.56900 1.000 C25 C -2.05300 1.76300 0.36400 1.000 C26 C -2.50100 0.62700 -0.55900 1.000 C27 C -8.22100 -0.75400 0.62500 1.000 C28 C -6.92900 -1.01700 0.98200 1.000 C29 C -5.87900 -0.36400 0.33100 1.000 C30 C -6.16700 0.56400 -0.68500 1.000 C31 C -7.48500 0.81400 -1.03900 1.000 C32 C -8.50500 0.15800 -0.38200 1.000 N33 N -4.52800 -0.40900 0.45500 1.000 C34 C -3.98300 0.40600 -0.40100 1.000 N35 N -4.94600 1.03000 -1.13200 1.000 C36 C -4.72900 2.01700 -2.19200 1.000 H37 H 3.38500 -3.89800 0.88200 1.000 H38 H 1.24900 -1.23000 -1.64000 1.000 H39 H -1.21600 -3.49800 1.53300 1.000 H40 H -1.06100 -4.61900 2.77600 1.000 H41 H 4.78600 -2.65700 -0.85600 1.000 H42 H 3.56700 -3.50800 -2.87600 1.000 H43 H 3.05300 -1.84100 -3.23100 1.000 H44 H 4.95300 -2.44600 -4.36200 1.000 H45 H 3.34800 -0.04400 -1.49700 1.000 H46 H 5.08900 -0.32300 -1.74300 1.000 H47 H 5.38800 -0.77200 0.65300 1.000 H48 H 3.63700 -0.60400 0.92600 1.000 H49 H 6.80900 1.37200 0.37400 1.000 H50 H 6.39700 3.92500 0.68100 1.000 H51 H 3.82100 5.46200 0.99500 1.000 H52 H 1.39400 5.20500 1.10200 1.000 H53 H 1.77400 0.97200 0.62200 1.000 H54 H -0.47100 3.53900 1.48500 1.000 H55 H -2.58700 2.67600 0.10100 1.000 H56 H -2.27300 1.49900 1.39800 1.000 H57 H -1.96700 -0.28600 -0.29600 1.000 H58 H -2.28100 0.89200 -1.59300 1.000 H59 H -9.02900 -1.26100 1.13000 1.000 H60 H -6.71900 -1.72900 1.76700 1.000 H61 H -7.71200 1.52300 -1.82200 1.000 H62 H -9.53200 0.35500 -0.65300 1.000 H63 H -4.63700 1.50600 -3.15100 1.000 H64 H -5.57400 2.70400 -2.22700 1.000 H65 H -3.81500 2.57400 -1.98800 1.000